IBS-ZINC05176853 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5290 -1.7820 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 -0.3280 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 1.0400 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 1.7530 2.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 1.4950 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 0.7060 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 -0.3350 -1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -0.9020 -2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -0.2050 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 0.7720 -2.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 -0.4400 -4.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5250 0.3110 -5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3150 1.1150 -4.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3300 -0.0570 -6.7090 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5170 0.5300 -7.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5190 -0.0510 -7.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 -0.5110 -9.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 -1.8840 -8.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -1.9450 -7.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -1.5430 -6.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7620 -2.1720 -6.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 -1.4460 -5.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -2.1240 -4.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -0.3380 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -1.0580 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 2.3430 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 0.9550 -7.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2810 -0.7440 -7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 0.2140 -9.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8170 -0.5560 -9.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -2.1130 -9.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 -2.6320 -8.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 -1.2480 -8.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -2.9580 -7.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 M END